#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d96 n SER 2 N 0.00 -5.13 -4.60 1.61 2.88 -1.26 -4.99 113.62 102.13 2d96 n SER 2 Ca 0.00 -0.62 -0.33 0.00 -1.33 0.00 0.00 58.87 56.60 2d96 n SER 2 Cb 0.00 -4.76 -0.10 0.00 -0.75 0.00 0.00 64.21 58.60 2d96 n SER 2 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2d96 s SER 3 N -3.53 4.69 -0.37 -3.46 0.01 -1.26 -5.02 113.70 104.76 2d96 s SER 3 Ca 0.48 -0.09 0.06 0.00 1.31 0.00 0.00 55.95 57.72 2d96 s SER 3 Cb -0.22 -1.14 0.27 0.00 0.21 0.00 0.00 66.02 65.14 2d96 s SER 3 CO 0.76 0.31 1.25 0.61 0.41 0.00 0.00 173.24 176.58 2d96 n GLY 4 N 1.75 0.58 2.77 3.44 0.00 -1.26 -5.12 105.19 107.36 2d96 n GLY 4 Ca -0.16 -0.07 -0.19 0.00 0.00 0.00 0.00 46.02 45.60 2d96 n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2d96 s SER 5 N -0.84 1.07 0.05 1.61 1.04 -1.26 -5.04 113.70 110.32 2d96 s SER 5 Ca 0.16 0.12 -0.22 0.00 0.48 0.00 0.00 55.95 56.49 2d96 s SER 5 Cb 0.28 0.16 -0.14 0.00 0.10 0.00 0.00 66.02 66.42 2d96 s SER 5 CO -0.06 -0.27 1.45 0.28 0.98 0.00 0.00 173.24 175.62 2d96 h SER 6 N 8.38 0.23 -1.12 7.02 0.02 -2.01 -3.49 113.55 122.58 2d96 h SER 6 Ca -0.14 -0.34 0.00 0.00 -0.84 0.00 0.00 61.79 60.47 2d96 h SER 6 Cb 1.13 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 63.60 2d96 h SER 6 CO 0.18 0.52 0.00 0.61 -1.14 0.00 0.00 176.83 177.00 2d96 n GLY 7 N -0.19 -0.91 0.22 -3.77 0.00 -1.26 -4.20 105.19 95.08 2d96 n GLY 7 Ca -0.06 -1.16 -0.13 0.00 0.00 0.00 0.00 46.02 44.67 2d96 n GLY 7 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2d96 h PRO 8 N 0.00 0.72 0.00 1.61 0.13 -2.07 -3.49 132.00 128.90 2d96 h PRO 8 Ca 0.00 -0.38 0.00 0.00 -0.87 0.00 0.00 66.00 64.75 2d96 h PRO 8 Cb 0.00 0.01 0.00 0.00 0.13 0.00 0.00 31.00 31.14 2d96 h PRO 8 CO 0.00 0.99 0.00 0.41 -0.23 0.00 0.00 178.00 179.17 2d96 n GLY 9 N 0.16 -1.00 3.56 1.56 0.00 -1.26 -5.13 105.19 103.08 2d96 n GLY 9 Ca -0.04 -1.13 -0.48 0.00 0.00 0.00 0.00 46.02 44.38 2d96 n GLY 9 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2d96 n LEU 10 N 0.00 1.20 -2.15 0.99 4.77 -1.26 -4.79 117.00 115.75 2d96 n LEU 10 Ca 0.00 1.15 -0.15 0.00 -0.03 0.00 0.00 56.01 56.98 2d96 n LEU 10 Cb 0.00 -1.19 -0.15 0.00 -2.33 0.00 0.00 43.42 39.75 2d96 n LEU 10 CO 0.00 -1.56 1.77 -1.20 -1.33 0.00 0.00 177.39 175.06 2d96 n SER 11 N 1.76 5.64 -4.68 -1.43 7.64 -1.26 -4.87 113.62 116.42 2d96 n SER 11 Ca 0.14 -2.55 -0.23 0.00 1.01 0.00 0.00 58.87 57.24 2d96 n SER 11 Cb 0.26 -1.42 -0.07 0.00 -1.01 0.00 0.00 64.21 61.97 2d96 n SER 11 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2d96 s LEU 12 N -0.16 3.19 -0.06 -3.43 1.43 -1.26 -5.12 118.68 113.26 2d96 s LEU 12 Ca 0.67 -0.76 -0.16 0.00 -1.03 0.00 0.00 54.13 52.84 2d96 s LEU 12 Cb 0.31 -1.66 -0.05 0.00 0.03 0.00 0.00 46.19 44.82 2d96 s LEU 12 CO -0.02 -0.17 0.42 -0.83 0.23 0.00 0.00 176.35 175.97 2d96 s GLY 13 N -3.76 2.42 0.35 -3.19 0.00 -1.26 -4.95 107.32 96.92 2d96 s GLY 13 Ca 0.35 -0.23 0.20 0.00 0.00 0.00 0.00 44.72 45.03 2d96 s GLY 13 CO 0.21 0.42 1.47 1.22 0.00 0.00 0.00 173.10 176.41 2d96 n ASP 14 N 2.72 0.32 -0.10 1.64 8.00 -1.26 0.16 116.55 128.03 2d96 n ASP 14 Ca -0.11 1.53 -0.12 0.00 0.71 0.00 0.00 54.79 56.80 2d96 n ASP 14 Cb 0.52 -0.75 -0.04 0.00 -0.02 0.00 0.00 41.12 40.84 2d96 n ASP 14 CO 0.00 0.00 0.00 0.74 -0.39 0.00 0.00 177.20 177.55 2d96 h THR 15 N 0.00 1.29 -0.53 -3.53 2.02 -2.01 -3.04 112.91 107.11 2d96 h THR 15 Ca 0.79 -1.15 0.11 0.00 0.77 0.00 0.00 66.41 66.93 2d96 h THR 15 Cb 2.12 1.42 -0.09 0.00 -1.74 0.00 0.00 68.15 69.86 2d96 h THR 15 CO -0.70 0.37 -0.06 0.00 0.37 0.00 0.00 175.52 175.50 2d96 h ALA 16 N 0.78 0.44 0.54 6.16 0.00 0.11 -2.61 119.26 124.68 2d96 h ALA 16 Ca 0.07 0.18 -0.02 0.00 0.00 0.00 0.00 54.91 55.14 2d96 h ALA 16 Cb 0.59 0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.70 2d96 h ALA 16 CO 0.03 -0.41 -0.42 -0.07 0.00 0.00 0.00 179.25 178.38 2d96 h LEU 17 N 0.06 -1.11 -0.78 0.00 3.38 -1.44 -1.82 115.31 113.60 2d96 h LEU 17 Ca 0.27 0.08 0.18 0.00 0.09 0.00 0.00 57.88 58.50 2d96 h LEU 17 Cb 0.41 0.35 -0.15 0.00 0.09 0.00 0.00 40.66 41.36 2d96 h LEU 17 CO -0.50 -0.60 -0.10 0.00 0.09 0.00 0.00 178.44 177.34 2d96 n GLN 18 N -5.01 -0.07 0.18 1.13 6.02 -1.01 -0.24 117.38 118.38 2d96 n GLN 18 Ca -0.11 1.20 -0.07 0.00 -0.01 0.00 0.00 57.00 58.00 2d96 n GLN 18 Cb 0.40 -1.84 -0.03 0.00 1.02 0.00 0.00 30.24 29.79 2d96 n GLN 18 CO 0.00 0.00 0.00 -0.91 -1.01 0.00 0.00 177.06 175.14 2d96 h ASN 19 N 0.00 -0.39 -0.99 1.08 2.35 -1.17 -2.97 115.58 113.48 2d96 h ASN 19 Ca 0.42 0.01 0.36 0.00 -0.55 0.00 0.00 56.30 56.54 2d96 h ASN 19 Cb 0.76 0.10 -0.16 0.00 0.05 0.00 0.00 38.32 39.06 2d96 h ASN 19 CO -0.77 -0.24 0.50 0.25 -1.65 0.00 0.00 177.43 175.52 2d96 h LEU 20 N -0.55 0.33 -0.41 1.61 7.12 -0.17 0.61 115.31 123.86 2d96 h LEU 20 Ca -0.05 0.23 0.06 0.00 0.13 0.00 0.00 57.88 58.26 2d96 h LEU 20 Cb 0.36 0.23 -0.06 0.00 -0.53 0.00 0.00 40.66 40.66 2d96 h LEU 20 CO 0.08 -0.29 0.08 -0.33 -0.13 0.00 0.00 178.44 177.84 2d96 h GLU 21 N 0.15 0.20 0.02 1.25 5.08 -0.54 -2.15 114.58 118.58 2d96 h GLU 21 Ca 0.77 -0.01 -0.22 0.00 -1.00 0.00 0.00 59.36 58.89 2d96 h GLU 21 Cb 1.88 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 31.08 2d96 h GLU 21 CO -0.70 0.13 -0.96 1.96 -1.00 0.00 0.00 179.01 178.44 2d96 h GLN 22 N 0.20 0.34 -0.31 2.33 4.20 0.18 -3.16 115.11 118.89 2d96 h GLN 22 Ca 0.20 -0.39 0.09 0.00 0.06 0.00 0.00 58.65 58.61 2d96 h GLN 22 Cb 0.24 0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.12 2d96 h GLN 22 CO -0.26 1.08 0.31 -0.07 -0.67 0.00 0.00 178.83 179.21 2d96 h LEU 23 N 0.18 0.00 0.00 1.46 3.38 0.02 0.55 115.31 120.90 2d96 h LEU 23 Ca -0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.89 2d96 h LEU 23 Cb 1.60 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.35 2d96 h LEU 23 CO 0.16 0.00 -0.53 0.18 0.09 0.00 0.00 178.44 178.34 2d96 n LEU 24 N -3.88 0.53 0.00 1.67 4.77 -0.86 -4.38 117.00 114.85 2d96 n LEU 24 Ca 0.05 0.06 -0.13 0.00 -0.03 0.00 0.00 56.01 55.96 2d96 n LEU 24 Cb 0.46 -0.24 -0.03 0.00 -2.33 0.00 0.00 43.42 41.28 2d96 n LEU 24 CO 0.29 0.08 -0.09 -0.90 -1.33 0.00 0.00 177.39 175.44 2d96 n ASP 25 N -1.64 1.78 -0.18 -1.43 5.68 0.19 -3.75 116.55 117.20 2d96 n ASP 25 Ca 0.05 -2.02 0.02 0.00 -0.50 0.00 0.00 54.79 52.35 2d96 n ASP 25 Cb 0.36 0.34 -0.01 0.00 -1.14 0.00 0.00 41.12 40.67 2d96 n ASP 25 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2d96 n GLY 26 N 1.47 -1.67 0.17 6.12 0.00 -1.26 -3.45 105.19 106.58 2d96 n GLY 26 Ca -0.06 -1.47 -0.13 0.00 0.00 0.00 0.00 46.02 44.36 2d96 n GLY 26 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2d96 h PRO 27 N -0.17 0.52 -0.91 1.61 0.13 -1.99 -3.19 132.00 128.00 2d96 h PRO 27 Ca -0.00 -0.28 0.06 0.00 -0.87 0.00 0.00 66.00 64.91 2d96 h PRO 27 Cb 0.17 0.01 -0.06 0.00 0.13 0.00 0.00 31.00 31.24 2d96 h PRO 27 CO 0.00 0.86 0.58 1.49 -0.23 0.00 0.00 178.00 180.70 2d96 h GLU 28 N 0.21 1.02 -4.48 0.86 4.81 -1.95 -3.43 114.58 111.63 2d96 h GLU 28 Ca 0.03 -0.06 -0.58 0.00 -0.13 0.00 0.00 59.36 58.62 2d96 h GLU 28 Cb 0.76 -0.23 -0.03 0.00 0.63 0.00 0.00 28.75 29.89 2d96 h GLU 28 CO 0.05 0.68 0.93 0.00 -0.73 0.00 0.00 179.01 179.94 2d96 n ALA 29 N -2.36 0.02 1.08 2.92 0.00 -1.21 -4.74 120.51 116.23 2d96 n ALA 29 Ca 0.13 0.17 0.03 0.00 0.00 0.00 0.00 53.44 53.78 2d96 n ALA 29 Cb 0.18 -1.54 0.10 0.00 0.00 0.00 0.00 19.45 18.19 2d96 n ALA 29 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2d96 n GLN 30 N 5.28 1.67 0.00 0.00 10.64 -1.26 -4.86 117.38 128.85 2d96 n GLN 30 Ca 0.39 -0.84 0.00 0.00 -1.83 0.00 0.00 57.00 54.72 2d96 n GLN 30 Cb -0.03 -1.31 0.00 0.00 -0.86 0.00 0.00 30.24 28.04 2d96 n GLN 30 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2d96 n GLY 31 N 0.69 4.38 3.55 2.61 0.00 -1.26 -4.74 105.19 110.43 2d96 n GLY 31 Ca 0.08 -0.44 -0.07 0.00 0.00 0.00 0.00 46.02 45.59 2d96 n GLY 31 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2d96 s SER 32 N 1.45 -0.26 -0.16 1.61 0.15 -1.26 -4.94 113.70 110.30 2d96 s SER 32 Ca 0.00 0.04 -0.10 0.00 0.70 0.00 0.00 55.95 56.59 2d96 s SER 32 Cb 0.00 0.26 -0.23 0.00 -1.71 0.00 0.00 66.02 64.34 2d96 s SER 32 CO 0.00 -0.41 0.23 -2.67 1.20 0.00 0.00 173.24 171.60 2d96 n TRP 33 N -0.06 1.02 -0.20 3.44 4.27 -1.25 -3.68 117.44 120.99 2d96 n TRP 33 Ca -0.05 0.27 -0.08 0.00 -3.89 0.00 0.00 57.50 53.75 2d96 n TRP 33 Cb 0.60 -1.13 -0.03 0.00 -1.36 0.00 0.00 31.31 29.39 2d96 n TRP 33 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 2d96 h ALA 34 N -0.13 -0.30 -0.36 -1.67 0.00 -1.96 0.11 119.26 114.95 2d96 h ALA 34 Ca -0.44 0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.58 2d96 h ALA 34 Cb 1.83 0.94 -0.02 0.00 0.00 0.00 0.00 17.79 20.54 2d96 h ALA 34 CO -0.03 -0.81 0.19 1.49 0.00 0.00 0.00 179.25 180.09 2d96 h GLU 35 N -0.23 0.51 -0.38 0.00 4.57 -2.00 -2.98 114.58 114.08 2d96 h GLU 35 Ca 0.18 -0.06 0.08 0.00 -1.18 0.00 0.00 59.36 58.38 2d96 h GLU 35 Cb 0.56 -0.10 -0.08 0.00 -0.16 0.00 0.00 28.75 28.97 2d96 h GLU 35 CO -0.68 0.43 -0.18 1.25 -1.18 0.00 0.00 179.01 178.64 2d96 h LEU 36 N 0.46 -0.62 -0.87 1.64 5.85 -1.23 -0.66 115.31 119.88 2d96 h LEU 36 Ca 0.13 0.14 0.22 0.00 0.84 0.00 0.00 57.88 59.21 2d96 h LEU 36 Cb 0.07 0.34 -0.13 0.00 0.37 0.00 0.00 40.66 41.31 2d96 h LEU 36 CO -0.02 -0.21 0.32 0.00 -0.34 0.00 0.00 178.44 178.19 2d96 h ALA 37 N 1.16 1.33 -0.84 1.25 0.00 -0.69 0.25 119.26 121.73 2d96 h ALA 37 Ca 0.19 0.18 -0.00 0.00 0.00 0.00 0.00 54.91 55.28 2d96 h ALA 37 Cb 0.40 0.21 -0.04 0.00 0.00 0.00 0.00 17.79 18.36 2d96 h ALA 37 CO -0.45 -0.38 0.51 0.93 0.00 0.00 0.00 179.25 179.85 2d96 h GLU 38 N 0.32 1.14 -0.81 0.00 5.08 -1.10 0.45 114.58 119.67 2d96 h GLU 38 Ca 0.54 -0.10 -0.01 0.00 -1.00 0.00 0.00 59.36 58.79 2d96 h GLU 38 Cb 1.04 -0.24 -0.04 0.00 0.50 0.00 0.00 28.75 30.01 2d96 h GLU 38 CO -0.57 0.80 0.45 0.00 -1.00 0.00 0.00 179.01 178.70 2d96 h ARG 39 N 1.16 1.13 -0.13 2.33 3.08 -0.14 -2.79 114.38 119.01 2d96 h ARG 39 Ca 0.30 -0.13 -0.21 0.00 0.07 0.00 0.00 59.98 60.01 2d96 h ARG 39 Cb -0.05 -0.22 0.01 0.00 0.08 0.00 0.00 29.97 29.78 2d96 h ARG 39 CO -0.06 0.83 -0.77 -0.07 -1.07 0.00 0.00 179.97 178.83 2d96 h LEU 40 N 1.12 0.82 0.00 3.04 3.38 -0.87 -3.48 115.31 119.33 2d96 h LEU 40 Ca 0.29 -0.54 0.00 0.00 0.09 0.00 0.00 57.88 57.72 2d96 h LEU 40 Cb 0.02 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.53 2d96 h LEU 40 CO -0.05 1.33 0.00 0.61 0.09 0.00 0.00 178.44 180.42 2d96 n GLY 41 N 0.67 0.72 2.54 0.83 0.00 0.43 -5.03 105.19 105.34 2d96 n GLY 41 Ca -0.07 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.61 2d96 n GLY 41 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2d96 n LEU 42 N 0.00 6.81 0.14 0.99 4.77 0.13 -4.62 117.00 125.22 2d96 n LEU 42 Ca 0.00 -4.71 0.13 0.00 -0.03 0.00 0.00 56.01 51.40 2d96 n LEU 42 Cb 0.00 -0.85 0.42 0.00 -2.33 0.00 0.00 43.42 40.66 2d96 n LEU 42 CO 0.00 1.79 0.88 0.08 -1.33 0.00 0.00 177.39 178.80 2d96 h ARG 43 N 2.50 0.00 0.00 3.23 0.11 -1.84 -2.93 114.38 115.44 2d96 h ARG 43 Ca 0.51 0.00 -0.30 0.00 0.10 0.00 0.00 59.98 60.30 2d96 h ARG 43 Cb 0.62 0.00 -0.05 0.00 1.11 0.00 0.00 29.97 31.65 2d96 h ARG 43 CO 1.31 0.00 -1.80 0.45 0.10 0.00 0.00 179.97 180.03 2d96 n SER 44 N -2.43 0.74 -0.08 0.08 2.88 -1.26 -3.93 113.62 109.62 2d96 n SER 44 Ca 0.04 0.35 0.14 0.00 -1.33 0.00 0.00 58.87 58.07 2d96 n SER 44 Cb 0.38 0.10 0.59 0.00 -0.75 0.00 0.00 64.21 64.53 2d96 n SER 44 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 2d96 n LEU 45 N -2.99 0.37 0.20 2.46 4.77 -1.19 -4.00 117.00 116.62 2d96 n LEU 45 Ca -0.19 0.10 0.12 0.00 -0.03 0.00 0.00 56.01 56.00 2d96 n LEU 45 Cb 1.06 -0.24 0.37 0.00 -2.33 0.00 0.00 43.42 42.28 2d96 n LEU 45 CO 0.45 0.07 1.10 0.58 -1.33 0.00 0.00 177.39 178.26 2d96 h VAL 46 N 0.38 0.04 0.10 4.08 2.07 -1.64 0.62 116.25 121.91 2d96 h VAL 46 Ca 0.00 0.00 -0.17 0.00 0.82 0.00 0.00 66.70 67.35 2d96 h VAL 46 Cb 0.38 0.24 0.01 0.00 -1.52 0.00 0.00 31.29 30.40 2d96 h VAL 46 CO 0.00 0.00 -0.77 -2.24 0.02 0.00 0.00 177.57 174.58 2d96 h ASP 47 N 0.00 0.33 0.00 0.57 2.03 -1.88 -2.85 116.42 114.62 2d96 h ASP 47 Ca 0.12 -0.92 0.00 0.00 -0.73 0.00 0.00 57.03 55.49 2d96 h ASP 47 Cb 1.74 -0.11 0.00 0.00 -0.83 0.00 0.00 39.33 40.14 2d96 h ASP 47 CO -0.00 1.36 0.08 0.00 -1.03 0.00 0.00 179.24 179.65 2d96 h THR 48 N -0.53 0.00 0.05 1.15 1.03 -0.03 0.04 112.91 114.63 2d96 h THR 48 Ca -0.15 0.00 -0.33 0.00 -0.01 0.00 0.00 66.41 65.92 2d96 h THR 48 Cb 1.51 0.69 -0.04 0.00 -1.07 0.00 0.00 68.15 69.25 2d96 h THR 48 CO 0.08 0.00 -1.84 -1.22 -0.01 0.00 0.00 175.52 172.53 2d96 n TYR 49 N -2.66 0.88 0.28 0.00 4.01 -1.04 -4.16 117.16 114.47 2d96 n TYR 49 Ca -0.02 0.27 0.16 0.00 -0.16 0.00 0.00 57.90 58.15 2d96 n TYR 49 Cb 0.13 -1.10 0.75 0.00 -0.31 0.00 0.00 39.34 38.80 2d96 n TYR 49 CO 0.00 0.00 0.00 0.07 -0.46 0.00 0.00 176.86 176.47 2d96 h ARG 50 N -0.47 0.00 -0.15 -0.72 0.11 -1.12 -3.03 114.38 109.00 2d96 h ARG 50 Ca -0.45 0.00 0.02 0.00 0.10 0.00 0.00 59.98 59.65 2d96 h ARG 50 Cb 1.70 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 32.76 2d96 h ARG 50 CO -0.11 0.06 0.04 0.37 0.10 0.00 0.00 179.97 180.43 2d96 h GLN 51 N 0.00 0.10 -7.07 0.08 -0.00 -1.18 -3.44 115.11 103.61 2d96 h GLN 51 Ca -0.00 -0.01 -0.45 0.00 -0.00 0.00 0.00 58.65 58.20 2d96 h GLN 51 Cb 0.43 -0.02 0.06 0.00 0.00 0.00 0.00 27.48 27.95 2d96 h GLN 51 CO 0.01 0.07 0.10 -0.08 0.00 0.00 0.00 178.83 178.92 2d96 s THR 52 N -6.19 2.45 -0.94 2.39 -1.32 -1.15 -4.98 115.64 105.90 2d96 s THR 52 Ca -0.13 -0.48 0.27 0.00 -1.21 0.00 0.00 61.69 60.15 2d96 s THR 52 Cb 0.09 -2.97 0.24 0.00 -1.51 0.00 0.00 72.50 68.34 2d96 s THR 52 CO 0.68 0.00 1.86 0.35 -2.21 0.00 0.00 174.62 175.30 2d96 n THR 53 N -2.65 0.21 -3.23 5.08 -2.24 -1.26 -4.09 114.28 106.09 2d96 n THR 53 Ca 0.09 -0.03 -0.34 0.00 -2.27 0.00 0.00 64.05 61.50 2d96 n THR 53 Cb 0.60 -0.57 -0.04 0.00 -2.10 0.00 0.00 70.33 68.22 2d96 n THR 53 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2d96 n SER 54 N -1.65 4.93 0.21 3.42 7.64 -1.26 -4.84 113.62 122.07 2d96 n SER 54 Ca 0.06 -3.44 0.08 0.00 1.01 0.00 0.00 58.87 56.58 2d96 n SER 54 Cb 0.34 -0.92 0.46 0.00 -1.01 0.00 0.00 64.21 63.08 2d96 n SER 54 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 2d96 h PRO 55 N 4.67 0.00 0.00 1.43 0.13 -1.71 -2.09 132.00 134.44 2d96 h PRO 55 Ca 0.20 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 65.14 2d96 h PRO 55 Cb 0.63 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.73 2d96 h PRO 55 CO 1.05 0.28 -1.41 1.03 -0.23 0.00 0.00 178.00 178.71 2d96 h SER 56 N 0.00 0.00 0.03 1.44 0.87 -1.88 -3.15 113.55 110.86 2d96 h SER 56 Ca -0.00 0.00 -0.11 0.00 -1.23 0.00 0.00 61.79 60.45 2d96 h SER 56 Cb 0.70 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 62.67 2d96 h SER 56 CO 0.04 0.67 -0.43 1.23 -0.53 0.00 0.00 176.83 177.80 2d96 h GLY 57 N 3.64 0.26 2.00 5.77 0.00 -1.83 -3.25 103.07 109.67 2d96 h GLY 57 Ca -0.18 -0.53 0.00 0.00 0.00 0.00 0.00 47.33 46.63 2d96 h GLY 57 CO 0.06 0.46 0.00 1.48 0.00 0.00 0.00 176.54 178.54 2d96 h SER 58 N -0.45 0.00 0.38 0.19 4.64 -1.56 -3.06 113.55 113.69 2d96 h SER 58 Ca -0.06 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 61.09 2d96 h SER 58 Cb 1.23 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.31 2d96 h SER 58 CO 0.08 0.00 -0.69 0.25 -0.87 0.00 0.00 176.83 175.60 2d96 h LEU 59 N 0.00 0.32 0.23 5.97 5.85 -1.59 -2.55 115.31 123.54 2d96 h LEU 59 Ca 0.00 -0.21 -0.01 0.00 0.84 0.00 0.00 57.88 58.50 2d96 h LEU 59 Cb 0.58 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 41.52 2d96 h LEU 59 CO 0.00 0.91 -0.11 -0.07 -0.34 0.00 0.00 178.44 178.83 2d96 h LEU 60 N 0.19 -0.26 -1.95 2.25 3.38 -1.57 -0.89 115.31 116.46 2d96 h LEU 60 Ca -0.02 0.01 0.17 0.00 0.09 0.00 0.00 57.88 58.13 2d96 h LEU 60 Cb 1.24 0.07 -0.02 0.00 0.09 0.00 0.00 40.66 42.04 2d96 h LEU 60 CO 0.11 0.06 0.52 0.08 0.09 0.00 0.00 178.44 179.30 2d96 h ARG 61 N -0.80 0.00 0.18 1.13 0.11 -1.68 0.14 114.38 113.45 2d96 h ARG 61 Ca -0.03 0.00 -0.32 0.00 0.10 0.00 0.00 59.98 59.73 2d96 h ARG 61 Cb 0.24 0.00 0.01 0.00 1.11 0.00 0.00 29.97 31.33 2d96 h ARG 61 CO 0.05 0.00 -1.48 0.77 0.10 0.00 0.00 179.97 179.41 2d96 h SER 62 N 0.00 0.60 -0.60 0.08 0.02 -1.49 -2.98 113.55 109.17 2d96 h SER 62 Ca 0.27 -0.71 0.15 0.00 -0.84 0.00 0.00 61.79 60.66 2d96 h SER 62 Cb 1.32 -0.19 -0.03 0.00 0.14 0.00 0.00 62.40 63.63 2d96 h SER 62 CO -0.00 1.57 0.42 0.22 -1.14 0.00 0.00 176.83 177.90 2d96 h TYR 63 N 0.10 0.17 0.11 3.45 3.20 0.76 -0.91 116.97 123.86 2d96 h TYR 63 Ca -0.24 0.00 -0.31 0.00 3.14 0.00 0.00 58.73 61.32 2d96 h TYR 63 Cb 2.07 -0.06 -0.01 0.00 1.54 0.00 0.00 36.73 40.28 2d96 h TYR 63 CO 0.09 0.07 -1.63 1.05 -1.64 0.00 0.00 178.16 176.10 2d96 h GLU 64 N 0.15 0.23 -0.65 1.82 4.11 -1.58 -2.16 114.58 116.50 2d96 h GLU 64 Ca 0.29 -0.39 0.08 0.00 0.07 0.00 0.00 59.36 59.41 2d96 h GLU 64 Cb 0.93 0.14 -0.04 0.00 0.50 0.00 0.00 28.75 30.28 2d96 h GLU 64 CO -0.04 1.06 0.43 -0.07 0.07 0.00 0.00 179.01 180.46 2d96 h LEU 65 N 0.06 0.51 -0.79 3.06 3.38 -1.02 0.04 115.31 120.56 2d96 h LEU 65 Ca -0.28 0.01 -0.11 0.00 0.09 0.00 0.00 57.88 57.59 2d96 h LEU 65 Cb 2.02 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 42.65 2d96 h LEU 65 CO 0.14 0.32 -0.50 0.00 0.09 0.00 0.00 178.44 178.49 2d96 h ALA 66 N 1.66 0.95 0.00 1.53 0.00 -1.51 -3.47 119.26 118.42 2d96 h ALA 66 Ca 0.29 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 54.74 2d96 h ALA 66 Cb 0.39 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2d96 h ALA 66 CO -0.09 0.63 0.00 0.41 0.00 0.00 0.00 179.25 180.20 2d96 n GLY 67 N 0.33 1.77 0.00 0.00 0.00 0.00 -5.14 105.19 102.14 2d96 n GLY 67 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2d96 n GLY 67 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2d96 n GLY 68 N -0.01 0.30 3.52 -0.02 0.00 -0.81 -5.02 105.19 103.16 2d96 n GLY 68 Ca 0.00 -1.79 -0.08 0.00 0.00 0.00 0.00 46.02 44.15 2d96 n GLY 68 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2d96 s ASP 69 N -1.00 -0.32 0.18 1.61 2.15 -1.26 -4.85 116.67 113.18 2d96 s ASP 69 Ca 0.00 -0.01 -0.20 0.00 0.43 0.00 0.00 52.55 52.76 2d96 s ASP 69 Cb 0.00 0.35 0.11 0.00 -0.30 0.00 0.00 42.92 43.08 2d96 s ASP 69 CO 0.00 -0.56 1.60 0.25 -0.17 0.00 0.00 175.17 176.29 2d96 h LEU 70 N 2.00 -0.99 -0.51 -1.34 5.85 -1.99 -2.04 115.31 116.29 2d96 h LEU 70 Ca -0.20 0.20 0.05 0.00 0.84 0.00 0.00 57.88 58.77 2d96 h LEU 70 Cb 1.23 0.50 -0.08 0.00 0.37 0.00 0.00 40.66 42.67 2d96 h LEU 70 CO 0.29 -0.29 -0.51 0.00 -0.34 0.00 0.00 178.44 177.59 2d96 h ALA 71 N 1.00 -0.68 -0.86 1.25 0.00 -1.98 0.11 119.26 118.11 2d96 h ALA 71 Ca 0.21 0.03 0.21 0.00 0.00 0.00 0.00 54.91 55.36 2d96 h ALA 71 Cb 0.52 1.16 -0.13 0.00 0.00 0.00 0.00 17.79 19.34 2d96 h ALA 71 CO -0.59 -0.95 0.30 0.78 0.00 0.00 0.00 179.25 178.79 2d96 h GLY 72 N -0.27 1.39 1.05 0.00 0.00 -1.79 0.44 103.07 103.88 2d96 h GLY 72 Ca 0.09 -0.10 -0.07 0.00 0.00 0.00 0.00 47.33 47.25 2d96 h GLY 72 CO -0.62 -0.29 0.16 -2.00 0.00 0.00 0.00 176.54 173.80 2d96 h LEU 73 N 0.31 1.01 -0.74 3.11 5.85 -0.49 -0.39 115.31 123.98 2d96 h LEU 73 Ca 0.53 -0.23 -0.13 0.00 0.84 0.00 0.00 57.88 58.88 2d96 h LEU 73 Cb 1.01 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.77 2d96 h LEU 73 CO -0.56 0.98 -0.52 -0.07 -0.34 0.00 0.00 178.44 177.93 2d96 h LEU 74 N 0.99 0.32 -0.44 2.25 3.38 0.16 -1.46 115.31 120.51 2d96 h LEU 74 Ca 0.21 -0.16 -0.18 0.00 0.09 0.00 0.00 57.88 57.84 2d96 h LEU 74 Cb 0.37 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.02 2d96 h LEU 74 CO 0.00 0.79 -0.70 -0.08 0.09 0.00 0.00 178.44 178.54 2d96 h GLU 75 N 0.23 0.39 0.14 1.13 4.57 0.02 -2.95 114.58 118.11 2d96 h GLU 75 Ca 0.01 -0.31 -0.01 0.00 -1.18 0.00 0.00 59.36 57.87 2d96 h GLU 75 Cb 1.00 0.06 0.00 0.00 -0.16 0.00 0.00 28.75 29.65 2d96 h GLU 75 CO 0.08 0.94 -0.07 0.00 -1.18 0.00 0.00 179.01 178.79 2d96 h ALA 76 N 0.97 -0.19 -0.99 2.92 0.00 -0.97 -3.22 119.26 117.78 2d96 h ALA 76 Ca -0.02 -0.23 0.23 0.00 0.00 0.00 0.00 54.91 54.88 2d96 h ALA 76 Cb 1.26 0.07 -0.12 0.00 0.00 0.00 0.00 17.79 19.01 2d96 h ALA 76 CO 0.12 -0.27 0.58 -0.07 0.00 0.00 0.00 179.25 179.61 2d96 h LEU 77 N -0.87 0.66 0.38 0.00 3.38 -1.36 -2.01 115.31 115.49 2d96 h LEU 77 Ca -0.02 0.13 -0.01 0.00 0.09 0.00 0.00 57.88 58.07 2d96 h LEU 77 Cb 0.53 0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.29 2d96 h LEU 77 CO 0.03 0.13 -0.40 -1.28 0.09 0.00 0.00 178.44 177.01 2d96 h SER 78 N 0.60 -1.09 -1.07 -0.43 0.87 -1.57 0.22 113.55 111.07 2d96 h SER 78 Ca 0.62 0.09 0.32 0.00 -1.23 0.00 0.00 61.79 61.59 2d96 h SER 78 Cb 1.14 0.36 -0.13 0.00 -0.44 0.00 0.00 62.40 63.34 2d96 h SER 78 CO -0.46 -0.52 0.66 -0.78 -0.53 0.00 0.00 176.83 175.20 2d96 h ASP 79 N -0.78 0.47 0.07 6.23 1.82 -1.38 0.62 116.42 123.47 2d96 h ASP 79 Ca -0.05 0.14 -0.18 0.00 -0.39 0.00 0.00 57.03 56.55 2d96 h ASP 79 Cb 0.68 0.08 -0.00 0.00 0.68 0.00 0.00 39.33 40.77 2d96 h ASP 79 CO -0.06 -0.04 -0.65 0.24 -1.61 0.00 0.00 179.24 177.12 2d96 h MET 80 N 0.34 0.56 0.00 0.28 2.86 -1.00 -3.47 114.93 114.49 2d96 h MET 80 Ca 0.70 -0.40 0.00 0.00 -2.06 0.00 0.00 59.70 57.93 2d96 h MET 80 Cb 1.73 0.07 0.00 0.00 0.06 0.00 0.00 31.60 33.46 2d96 h MET 80 CO -0.46 1.02 0.00 0.41 1.06 0.00 0.00 176.91 178.94 2d96 n GLY 81 N 0.45 1.12 2.38 8.32 0.00 0.22 -4.95 105.19 112.73 2d96 n GLY 81 Ca -0.04 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.59 2d96 n GLY 81 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2d96 n LEU 82 N 0.00 8.36 0.32 0.99 4.77 -0.51 -4.62 117.00 126.32 2d96 n LEU 82 Ca 0.00 -4.28 0.21 0.00 -0.03 0.00 0.00 56.01 51.91 2d96 n LEU 82 Cb 0.00 -1.56 1.10 0.00 -2.33 0.00 0.00 43.42 40.63 2d96 n LEU 82 CO 0.00 1.88 1.15 1.05 -1.33 0.00 0.00 177.39 180.14 2d96 h GLU 83 N 5.20 0.00 0.04 3.23 4.11 -1.90 -2.55 114.58 122.70 2d96 h GLU 83 Ca 0.82 0.00 -0.00 0.00 0.07 0.00 0.00 59.36 60.25 2d96 h GLU 83 Cb 0.33 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.58 2d96 h GLU 83 CO 1.79 0.01 -0.02 1.49 0.07 0.00 0.00 179.01 182.35 2d96 h GLU 84 N 0.00 -0.05 -0.57 1.06 4.57 -1.98 -2.02 114.58 115.60 2d96 h GLU 84 Ca -0.00 0.00 -0.09 0.00 -1.18 0.00 0.00 59.36 58.09 2d96 h GLU 84 Cb 0.07 0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 28.65 2d96 h GLU 84 CO 0.00 0.06 -0.00 0.78 -1.18 0.00 0.00 179.01 178.67 2d96 h GLY 85 N -0.14 1.07 0.87 1.92 0.00 -1.84 -2.76 103.07 102.20 2d96 h GLY 85 Ca -0.00 -0.76 0.03 0.00 0.00 0.00 0.00 47.33 46.59 2d96 h GLY 85 CO 0.01 0.70 0.38 -2.08 0.00 0.00 0.00 176.54 175.56 2d96 h VAL 86 N 0.91 1.08 -0.25 4.60 2.07 -1.43 -0.77 116.25 122.45 2d96 h VAL 86 Ca 0.16 -0.26 -0.05 0.00 0.82 0.00 0.00 66.70 67.37 2d96 h VAL 86 Cb 0.53 0.25 -0.01 0.00 -1.52 0.00 0.00 31.29 30.54 2d96 h VAL 86 CO 0.03 0.14 -0.08 0.03 0.02 0.00 0.00 177.57 177.70 2d96 h ARG 87 N 0.76 0.40 0.43 1.57 3.08 -1.24 -2.69 114.38 116.69 2d96 h ARG 87 Ca 0.25 -0.09 -0.02 0.00 0.07 0.00 0.00 59.98 60.19 2d96 h ARG 87 Cb 0.02 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.02 2d96 h ARG 87 CO -0.10 0.49 -0.21 1.25 -1.07 0.00 0.00 179.97 180.33 2d96 h LEU 88 N 0.38 -0.49 -0.86 3.04 6.46 -1.05 -2.77 115.31 120.01 2d96 h LEU 88 Ca 0.08 -0.07 0.22 0.00 -0.12 0.00 0.00 57.88 57.99 2d96 h LEU 88 Cb 0.39 0.13 -0.14 0.00 -0.73 0.00 0.00 40.66 40.31 2d96 h LEU 88 CO 0.02 -0.07 0.25 -0.07 -0.62 0.00 0.00 178.44 177.95 2d96 h LEU 89 N -1.06 0.05 -0.70 2.25 3.38 -1.15 0.27 115.31 118.34 2d96 h LEU 89 Ca -0.06 0.19 0.01 0.00 0.09 0.00 0.00 57.88 58.10 2d96 h LEU 89 Cb 0.54 0.24 -0.03 0.00 0.09 0.00 0.00 40.66 41.49 2d96 h LEU 89 CO 0.10 -0.12 0.47 0.03 0.09 0.00 0.00 178.44 179.00 2d96 h ARG 90 N 0.24 0.93 0.00 1.13 3.08 -1.51 -3.49 114.38 114.76 2d96 h ARG 90 Ca 0.54 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.53 2d96 h ARG 90 Cb 1.06 -0.21 0.00 0.00 0.08 0.00 0.00 29.97 30.90 2d96 h ARG 90 CO -0.62 0.62 0.00 0.41 -1.07 0.00 0.00 179.97 179.30 2d96 n GLY 91 N -1.29 -2.69 3.70 0.04 0.00 0.95 -4.89 105.19 101.01 2d96 n GLY 91 Ca 0.06 -1.37 -0.42 0.00 0.00 0.00 0.00 46.02 44.29 2d96 n GLY 91 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2d96 s PRO 92 N -3.56 4.30 0.08 1.61 0.04 -1.26 -4.97 135.00 131.24 2d96 s PRO 92 Ca 0.00 2.02 -0.31 0.00 0.04 0.00 0.00 61.00 62.76 2d96 s PRO 92 Cb 0.00 -3.45 -0.08 0.00 0.04 0.00 0.00 34.50 31.01 2d96 s PRO 92 CO 0.00 -0.52 1.53 -2.00 0.04 0.00 0.00 177.00 176.05 2d96 s GLU 93 N 1.90 4.24 -0.43 4.56 2.12 -1.26 -4.98 118.70 124.85 2d96 s GLU 93 Ca 0.65 2.21 -0.09 0.00 0.36 0.00 0.00 54.97 58.09 2d96 s GLU 93 Cb -0.34 -3.44 0.08 0.00 0.26 0.00 0.00 34.13 30.69 2d96 s GLU 93 CO 0.28 -0.62 0.28 0.99 -0.54 0.00 0.00 175.26 175.65 2d96 s THR 94 N 2.02 4.27 -0.17 -1.70 2.01 -1.26 -4.94 115.64 115.87 2d96 s THR 94 Ca 0.69 -1.43 -0.23 0.00 0.31 0.00 0.00 61.69 61.04 2d96 s THR 94 Cb -0.38 -3.64 -0.20 0.00 0.01 0.00 0.00 72.50 68.29 2d96 s THR 94 CO 0.30 -0.54 0.42 -0.09 -0.69 0.00 0.00 174.62 174.02 2d96 h ARG 95 N 8.43 0.00 -3.22 4.92 2.43 -2.06 -3.48 114.38 121.39 2d96 h ARG 95 Ca -0.23 0.00 -0.15 0.00 -0.81 0.00 0.00 59.98 58.79 2d96 h ARG 95 Cb 1.08 0.00 -0.23 0.00 -0.42 0.00 0.00 29.97 30.40 2d96 h ARG 95 CO 0.78 0.87 -0.42 -0.51 -1.51 0.00 0.00 179.97 179.17 2d96 s ASP 96 N -6.41 -0.17 0.13 -3.80 1.01 -1.26 -5.17 116.67 101.00 2d96 s ASP 96 Ca -0.22 0.24 0.10 0.00 0.71 0.00 0.00 52.55 53.38 2d96 s ASP 96 Cb 0.01 0.39 -0.04 0.00 1.01 0.00 0.00 42.92 44.29 2d96 s ASP 96 CO 0.57 -0.22 -0.24 -0.54 0.21 0.00 0.00 175.17 174.95 2d96 s LYS 97 N -0.51 1.53 -0.08 8.23 1.02 -1.26 -5.14 119.74 123.53 2d96 s LYS 97 Ca -0.06 -1.31 -0.18 0.00 0.02 0.00 0.00 55.97 54.44 2d96 s LYS 97 Cb -0.04 -1.96 0.04 0.00 -0.52 0.00 0.00 37.83 35.35 2d96 s LYS 97 CO 0.01 0.45 0.43 -0.51 -0.92 0.00 0.00 175.35 174.82 2d96 s LEU 98 N -2.14 0.34 -0.43 3.17 1.43 -1.26 -5.12 118.68 114.68 2d96 s LEU 98 Ca 0.16 0.52 -0.28 0.00 -1.03 0.00 0.00 54.13 53.50 2d96 s LEU 98 Cb -0.10 1.62 -0.01 0.00 0.03 0.00 0.00 46.19 47.72 2d96 s LEU 98 CO 0.08 -0.37 1.75 -2.16 0.23 0.00 0.00 176.35 175.88 2d96 s PRO 99 N -0.70 3.17 -0.43 1.29 0.04 -1.26 -4.91 135.00 132.20 2d96 s PRO 99 Ca -0.08 1.10 -0.28 0.00 0.04 0.00 0.00 61.00 61.78 2d96 s PRO 99 Cb -0.03 -4.22 -0.08 0.00 0.04 0.00 0.00 34.50 30.20 2d96 s PRO 99 CO 0.04 -2.06 2.35 0.45 0.04 0.00 0.00 177.00 177.82 2d96 n SER 100 N 10.75 2.39 -4.55 6.66 2.88 -1.26 -4.93 113.62 125.56 2d96 n SER 100 Ca 0.21 -0.10 -0.35 0.00 -1.33 0.00 0.00 58.87 57.29 2d96 n SER 100 Cb 0.48 -1.47 -0.11 0.00 -0.75 0.00 0.00 64.21 62.36 2d96 n SER 100 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 2d96 s THR 101 N 10.08 4.60 -0.04 2.46 2.01 -1.26 -5.09 115.64 128.40 2d96 s THR 101 Ca 1.04 -0.09 0.02 0.00 0.31 0.00 0.00 61.69 62.97 2d96 s THR 101 Cb -0.42 -3.11 0.01 0.00 0.01 0.00 0.00 72.50 68.99 2d96 s THR 101 CO 0.34 0.40 -0.08 -1.61 -0.69 0.00 0.00 174.62 172.98 2d96 s GLU 102 N 0.94 1.10 -0.57 4.92 0.41 -1.26 -5.03 118.70 119.21 2d96 s GLU 102 Ca 0.04 -0.27 0.01 0.00 -0.41 0.00 0.00 54.97 54.34 2d96 s GLU 102 Cb -0.14 -1.00 0.50 0.00 -1.78 0.00 0.00 34.13 31.71 2d96 s GLU 102 CO 0.03 0.03 1.91 1.33 -0.49 0.00 0.00 175.26 178.06 2d96 n VAL 103 N 3.66 3.39 0.11 2.63 0.24 -1.26 -4.63 118.33 122.46 2d96 n VAL 103 Ca -0.22 -2.81 -0.12 0.00 -2.04 0.00 0.00 64.34 59.15 2d96 n VAL 103 Cb 0.52 -0.96 -0.08 0.00 -1.47 0.00 0.00 33.84 31.86 2d96 n VAL 103 CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 2d96 h SER 104 N 1.74 -0.28 -4.51 -1.34 0.02 -2.05 -3.50 113.55 103.63 2d96 h SER 104 Ca 0.57 -0.25 0.00 0.00 -0.84 0.00 0.00 61.79 61.28 2d96 h SER 104 Cb 1.38 0.07 0.00 0.00 0.14 0.00 0.00 62.40 64.00 2d96 h SER 104 CO 1.35 0.18 0.00 0.61 -1.14 0.00 0.00 176.83 177.83 2d96 n GLY 105 N 0.15 0.75 3.74 -3.77 0.00 -1.26 -5.07 105.19 99.73 2d96 n GLY 105 Ca -0.09 -2.13 -0.41 0.00 0.00 0.00 0.00 46.02 43.40 2d96 n GLY 105 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2d96 s PRO 106 N -0.99 4.41 0.22 1.61 0.04 -1.26 -5.04 135.00 133.99 2d96 s PRO 106 Ca 0.00 2.05 0.01 0.00 0.04 0.00 0.00 61.00 63.09 2d96 s PRO 106 Cb 0.00 -3.18 -0.05 0.00 0.04 0.00 0.00 34.50 31.31 2d96 s PRO 106 CO 0.00 -0.20 0.08 -1.12 0.04 0.00 0.00 177.00 175.80 2d96 s SER 107 N 0.12 0.93 -0.03 6.66 0.01 -1.26 -5.17 113.70 114.97 2d96 s SER 107 Ca 0.54 -1.32 0.03 0.00 1.31 0.00 0.00 55.95 56.52 2d96 s SER 107 Cb -0.36 0.20 -0.00 0.00 0.21 0.00 0.00 66.02 66.07 2d96 s SER 107 CO 0.40 -0.71 -0.13 -0.44 0.41 0.00 0.00 173.24 172.77 2d96 s SER 108 N -3.23 1.62 0.00 2.44 0.01 -1.26 -5.32 113.70 107.96 2d96 s SER 108 Ca 0.34 -0.26 0.00 0.00 1.31 0.00 0.00 55.95 57.34 2d96 s SER 108 Cb 0.07 -0.39 0.00 0.00 0.21 0.00 0.00 66.02 65.91 2d96 s SER 108 CO 0.10 0.12 0.00 0.61 0.41 0.00 0.00 173.24 174.48